1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-bromanyl-indole-3-carbonitrile

Systemtic Name: 1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-bromanyl-indole-3-carbonitrile Openeye Name: 1-[2-(azepan-1-yl)-2-oxo-ethyl]-5-bromo-indole-3-carbonitrile CAS Name: 1-[2-(1-azepanyl)-2-oxoethyl]-5-bromo-3-indolecarbonitrile IUPAC Name: 1-[2-(azepan-1-yl)-2-oxoethyl]-5-bromoindole-3-carbonitrile Traditional Name: 1-[2-(azepan-1-yl)-2-keto-ethyl]-5-bromo-indole-3-carbonitrile Formula: C17H18BrN3O MolecularWeight: 360.24832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C=C(C3=C2C=CC(=C3)Br)C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C=C(C3=C2C=CC(=C3)Br)C#N

InChI

InChI=1S/C17H18BrN3O/c18-14-5-6-16-15(9-14)13(10-19)11-21(16)12-17(22)20-7-3-1-2-4-8-20/h5-6,9,11H,1-4,7-8,12H2